SCHEMBL6973361

SCHEMBL6973361

Nc1ccc2c(c1)CCNC2C(=S)CCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 1/20 0.41
▸ TBXA2R P21731 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ MAOA P21397 2/20 0.37
▸ MAOB P27338 2/20 0.37
▸ SLC22A1 O15245 1/20 0.36
▸ PRCP P42785 1/20 0.36
▸ KDM1A O60341 2/20 0.36
▸ GRIN2B Q13224 1/20 0.36
▸ SLC6A2 P23975 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6974470 0.88 ADRB2 (0.42) ADRB2TBXA2RTSHRNPSR1SLC22A1
SCHEMBL6967303 0.83 TBXA2R (0.40) ADRB2TBXA2RTSHRNPSR1MAOA
SCHEMBL6968049 0.78 TSHR (0.47) ADRB2TBXA2RTSHRNPSR1SLC22A1
SCHEMBL6967406 0.74 TSHR (0.42) ADRB2TBXA2RTSHRNPSR1KDM1A
SCHEMBL6973488 0.71 TSHR (0.44) TBXA2RTSHRNPSR1KDM1ASLC6A2
SCHEMBL6974416 0.70 TBXA2R (0.41) ADRB2TBXA2RTSHRNPSR1MAOA
SCHEMBL8471637 0.70 OPRM1 (0.42) TBXA2RTSHRNPSR1
SCHEMBL6967844 0.70 OPRM1 (0.42) TBXA2RTSHRNPSR1
SCHEMBL6973757 0.68 TBXA2R (0.40) ADRB2TBXA2RTSHRNPSR1KDM1A
SCHEMBL8472080 0.68 KDM1A (0.47) ADRB2TBXA2RMAOBKDM1A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832069-B1 BIPHENYL-2-CARBOXYLIC ACID-TETRAHYDRO-ISOQUINOLIN-6-YL AMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN AND/OR APOLIPOPROTEIN B (Apo B) SECRETION PFIZER (US) 2003-03-05 — — EP disclosed
EP-1181954-A2 Biphenyl-2-carboxylic acid-tetrahydro-isoquinolin-6-yl amide derivatives, their preparation and use as inhibitors of microsomal triglyceride transfer protein and/or apolipoprotein B (ApoB) secretion PFIZER INC. (US) 2002-02-27 — — EP disclosed
US-5919795-A ATHEROSCLEROSIS THERAPY PFIZER INC. (US) 1999-07-06 — — US disclosed
EP-0832069-A1 BIPHENYL-2-CARBOXYLIC ACID-TETRAHYDRO-ISOQUINOLIN-6-YL AMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN AND/OR APOLIPOPROTEIN B (Apo B) SECRETION PFIZER INC. (US) 1998-04-01 — — EP disclosed
WO-1996040640-A1 BIPHENYL-2-CARBOXYLIC ACID-TETRAHYDRO-ISOQUINOLIN-6-YL AMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN AND/OR APOLIPOPROTEIN B (Apo B) SECRETION PFIZER INC. (US) 1996-12-19 — — WO disclosed
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